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Application Area
Environmental
Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research
Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Quetiapine-[d4] fumarate

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General Information
Catalog: BLP-013116
CAS: 1287376-15-1
Molecular Formula: C25H25D4N3O6S
Molecular Weight: 503.60
Chemical Structure
Quetiapine-[d4] fumarate
Description An isotope labelled form of Quetiapine fumarate, a 5-HT receptor antagonist, which is widely used as an antipsychotic drug.
Synonyms 2-[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethanol-d4 (2E)-2-Butenedioate
IUPAC Name 2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]-1,1,2,2-tetradeuterioethanol;(E)-but-2-enedioic acid
Related CAS 1331636-50-0 111974-72-2 (unlabelled)
Canonical SMILES C1CN(CCN1CCOCCO)C2=NC3=CC=CC=C3SC4=CC=CC=C42.C(=CC(=O)O)C(=O)O
InChI InChI=1S/C21H25N3O2S.C4H4O4/c25-14-16-26-15-13-23-9-11-24(12-10-23)21-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)22-21;5-3(6)1-2-4(7)8/h1-8,25H,9-16H2;1-2H,(H,5,6)(H,7,8)/b;2-1+/i14D2,16D2;
InChI Key VRHJBWUIWQOFLF-SQGQDMBVSA-N
Purity 98%
Solubility 10 mM in DMSO
Appearance Powder
Application The isotope labelled form of Quetiapine fumarate.
Shelf Life As supplied, 2 years from the QC date provided on the Certificate of Analysis, when stored properly
Storage -20°C Freeze
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